Monomers
Ethyl 2-chloroacrylate
Identifiers
IUPAC name
ethyl 2-chloroprop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InchI Key
CVUNPKSKGHPMSY-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)Cl
Canonical SMILES
CCOC(=O)C(=C)Cl
Isomeric SMILES
CCOC(=O)C(=C)Cl
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7ClO2
Heavy Atom Count
8
Molecular Weight
134.562
Exact Molecular Weight
134.0135
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.302
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
15 14 0 0 0 0 0 0 0 0999 V2000
-2.2387 0.2350 -0.3797 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5613 -0.7949 0.4778 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2260 -1.0456 0.0995 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6921 -0.0311 0.1147 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2887 1.1076 0.4756 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1056 -0.2348 -0.2715 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9247 0.7817 -0.2321 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6815 -1.7854 -0.7693 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.7336 0.4315 -1.3331 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3676 1.2214 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2955 -0.0845 -0.6086 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1337 -1.7517 0.3874 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6638 -0.4729 1.5255 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5651 1.7455 0.0778 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9627 0.6783 -0.5049 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers